Thiazinamium chloride
Basic information
- CAS
4320-13-2- Standard SMILES
CC(CN1c2ccccc2Sc2ccccc21)[N+](C)(C)C.[Cl-]- InChIKey
NGYRQLDJZVHTFE-UHFFFAOYSA-M- Molecular formula
- C18H23ClN2S
- Average molar mass
- 334.9 g/mol
- Monoisotopic mass
- 334.1270476
Names & identifiers
- Preferred name
- Thiazinamium chloride
- IUPAC
- trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium chloride
- English name
- Thiazinamium chloride
- Molecular formula
- C18H23ClN2S
- Molecular weight
- 334.90662
Names & synonyms
THIAZINAMIUM CHLORIDE4320-13-2WY-460EThiazinamium chloride [USAN]trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium;chloride89SV0QH69QThiazinamium chloride (USAN)Trimethyl(1-methyl-2-phenothiazin-10-ylethyl)-ammonium chlorideN,N,N-Trimethyl-1-(10H-phenothiazin-10-yl)propan-2-aminium chlorideUNII-89SV0QH69QSCHEMBL635014orb1708368
Show more names
Multergan chloride
CHEMBL2107499DTXSID40962956HY-U00267AKOS040740257CS-7198DA-68142D06107T13144
Database identifiers
- CAS
4320-13-2- PubChem CID
- 20316
- DTXSID
DTXSID40962956- ChEMBL
CHEMBL2107499- UNII
- 89SV0QH69Q
Properties
Computed structural properties
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 330
Physicochemical properties
- Melting point
- 267 °C · 267 °C
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- FDA UNII
- 89 SV0QH69Q · 89SV0QH69Q
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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